3-[(1-ethyl-7,8-dimethoxy-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)methyl]benzamide

Systemtic Name: 3-[(1-ethyl-7,8-dimethoxy-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)methyl]benzamide Openeye Name: 3-[(1-ethyl-7,8-dimethoxy-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)methyl]benzamide CAS Name: 3-[(1-ethyl-7,8-dimethoxy-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)methyl]benzamide IUPAC Name: 3-[(1-ethyl-7,8-dimethoxy-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)methyl]benzamide Traditional Name: 3-[(1-ethyl-2-keto-7,8-dimethoxy-5-phenyl-3H-1,4-benzodiazepin-3-yl)methyl]benzamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=C(C=C2C(=NC(C1=O)CC3=CC=CC(=C3)C(=O)N)C4=CC=CC=C4)OC)OC

Isomeric SMILES

CCN1C2=CC(=C(C=C2C(=NC(C1=O)CC3=CC=CC(=C3)C(=O)N)C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C27H27N3O4/c1-4-30-22-16-24(34-3)23(33-2)15-20(22)25(18-10-6-5-7-11-18)29-21(27(30)32)14-17-9-8-12-19(13-17)26(28)31/h5-13,15-16,21H,4,14H2,1-3H3,(H2,28,31)